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DocumentationIdentifier: MM150074
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM150074 |
| SMILES |
CCN(C=N)CC(N)=O
|
| InChIKey |
IGGQCLYXZFCZSY-UHFFFAOYSA-N
|
| MW [Da] |
129.16
Automatically obtained from RDkit software. |
| LogP |
-0.6
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM104380
Similarity: 0.75
Similarity to MM104380
| Tanimoto metric | 0.75 |
|---|---|
| Cosine metric | 0.866 |
| Dice metric | 0.8571 |
| MW: | 115.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.99 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM133758
Similarity: 0.7453
Similarity to MM133758
| Tanimoto metric | 0.7453 |
|---|---|
| Cosine metric | 0.8577 |
| Dice metric | 0.8541 |
| MW: | 129.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.6 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM268898
Similarity: 0.6031
Similarity to MM268898
| Tanimoto metric | 0.6031 |
|---|---|
| Cosine metric | 0.7679 |
| Dice metric | 0.7524 |
| MW: | 144.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.66 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+22 more
